4I30
Crystal structure of Canavalia maritima seeds lectin (ConM) co-crystalized with gamma-aminobutyric acid (GABA) and soaked with adenine
Replaces: 3S0SExperimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE D03B-MX1 |
| Synchrotron site | LNLS |
| Beamline | D03B-MX1 |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2010-05-05 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.427 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 66.990, 70.410, 97.050 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 57.000 - 1.890 |
| R-factor | 0.22438 |
| Rwork | 0.222 |
| R-free | 0.26413 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.026 |
| RMSD bond angle | 2.577 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.000 | 1.990 |
| High resolution limit [Å] | 1.890 | 1.890 |
| Rmerge | 0.071 | 0.366 |
| Number of reflections | 16822 | |
| <I/σ(I)> | 5.7 | 2.1 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 4.7 | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 2.0 M Ammonium sulphate, pH 8.5 , VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
